{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0647644 0.143829 0.6473224 ] [ 1.313892 1.683397 0.0769283 ] [ 0.1194939 2.399252 1.546304 ] [ 2.728192 0.2406182 0.1106797 ] [ 2.458193 2.956348 2.547264 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.47644e-12 1.43829e-11 6.473223999999999e-11 ] [ 1.313892e-10 1.683397e-10 7.69283e-12 ] [ 1.194939e-11 2.399252e-10 1.546304e-10 ] [ 2.728192e-10 2.406182e-11 1.106797e-11 ] [ 2.458193e-10 2.956348e-10 2.547264000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3249414 -15.8890834 1.4995396 ] [ 5.5973772 9.9211429 -14.9975581 ] [ -5.3127215 10.7767131 11.6708861 ] [ 13.3685201 -6.1286612 -0.5353437 ] [ 0.6717656 1.3198886 2.3624762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.295108620541002e-08 -2.545711794942138e-08 2.402527289083784e-09 ] [ 8.967986887638966e-09 1.589542320599591e-08 -2.402873695690967e-08 ] [ -8.511918180121507e-09 1.726619777788909e-08 1.869882085343969e-08 ] [ 2.141873035891488e-08 -9.819197691444072e-09 -8.57715160232569e-10 ] [ 1.076287138977684e-09 2.114694656980443e-09 3.785104134836425e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.1876156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.709299811217365e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.549934 -0.4604218 0.2937412 ] [ 0.9577298 1.3121722 -0.0456788 ] [ 0.6097952 2.9619812 1.5936631 ] [ 3.1618697 0.5068811 0.1080291 ] [ 2.5050746 3.1028315 2.9787439 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.499340000000001e-11 -4.604218e-11 2.937412e-11 ] [ 9.577298e-11 1.3121722e-10 -4.56788e-12 ] [ 6.097952e-11 2.9619812e-10 1.5936631e-10 ] [ 3.1618697e-10 5.068811e-11 1.080291e-11 ] [ 2.5050746e-10 3.1028315e-10 2.9787439e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -2.08e-05 2.2e-06 ] [ 1.87e-05 4.22e-05 2.39e-05 ] [ -9e-07 1.31e-05 8.6e-06 ] [ 2e-07 -3e-07 1.43e-05 ] [ -1.6e-05 -3.41e-05 -4.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -3.332527371264e-14 3.52478856576e-15 ] [ 2.996070280896e-14 6.761185339776e-14 3.829202123712e-14 ] [ -1.44195895872e-15 2.098851373248e-14 1.377871893888e-14 ] [ 3.2043532416e-16 -4.8065298624e-16 2.291112567744e-14 ] [ -2.56348259328e-14 -5.463422276928e-14 -7.834643675712001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.2599996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.483615486773735e-18 } }